# generated using pymatgen data_Ca5Sb12Rh19 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 13.80322261 _cell_length_b 13.80322207 _cell_length_c 4.14282951 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00000128 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ca5Sb12Rh19 _chemical_formula_sum 'Ca5 Sb12 Rh19' _cell_volume 683.57890865 _cell_formula_units_Z 1 loop_ _symmetry_equiv_pos_site_id _symmetry_equiv_pos_as_xyz 1 'x, y, z' loop_ _atom_site_type_symbol _atom_site_label _atom_site_symmetry_multiplicity _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_occupancy Ca Ca0 1 0.00000000 0.18538506 0.50000000 1.0 Ca Ca1 1 0.81461494 0.81461494 0.50000000 1.0 Ca Ca2 1 0.18538506 0.00000000 0.50000000 1.0 Ca Ca3 1 0.66666700 0.33333300 0.00000000 1.0 Ca Ca4 1 0.33333300 0.66666700 0.00000000 1.0 Sb Sb5 1 0.48440312 0.32273644 0.50000000 1.0 Sb Sb6 1 0.82021426 0.00000000 0.00000000 1.0 Sb Sb7 1 0.17978574 0.17978574 0.00000000 1.0 Sb Sb8 1 1.00000000 0.82021426 0.00000000 1.0 Sb Sb9 1 0.36679554 0.00000000 0.00000000 1.0 Sb Sb10 1 0.67726356 0.16166668 0.50000000 1.0 Sb Sb11 1 0.83833332 0.51559688 0.50000000 1.0 Sb Sb12 1 0.51559688 0.83833332 0.50000000 1.0 Sb Sb13 1 0.16166668 0.67726356 0.50000000 1.0 Sb Sb14 1 0.32273644 0.48440312 0.50000000 1.0 Sb Sb15 1 1.00000000 0.36679554 0.00000000 1.0 Sb Sb16 1 0.63320446 0.63320446 0.00000000 1.0 Rh Rh17 1 0.80352514 0.17883679 0.00000000 1.0 Rh Rh18 1 0.37531165 0.19647486 0.00000000 1.0 Rh Rh19 1 0.65015925 0.52117339 0.50000000 1.0 Rh Rh20 1 0.87101414 0.34984075 0.50000000 1.0 Rh Rh21 1 0.34984075 0.87101414 0.50000000 1.0 Rh Rh22 1 0.52117339 0.65015925 0.50000000 1.0 Rh Rh23 1 0.12898586 0.47882661 0.50000000 1.0 Rh Rh24 1 0.82116321 0.62468835 0.00000000 1.0 Rh Rh25 1 0.62468835 0.82116321 0.00000000 1.0 Rh Rh26 1 0.17883679 0.80352514 0.00000000 1.0 Rh Rh27 1 0.19647486 0.37531165 0.00000000 1.0 Rh Rh28 1 1.00000000 0.71604918 0.50000000 1.0 Rh Rh29 1 0.28395082 0.28395082 0.50000000 1.0 Rh Rh30 1 0.71604918 0.00000000 0.50000000 1.0 Rh Rh31 1 1.00000000 0.55407798 0.00000000 1.0 Rh Rh32 1 0.44592202 0.44592202 0.00000000 1.0 Rh Rh33 1 0.55407798 0.00000000 0.00000000 1.0 Rh Rh34 1 0.00000000 0.00000000 0.00000000 1.0 Rh Rh35 1 0.47882661 0.12898586 0.50000000 1.0